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#$Date: 2013-05-01 01:03:20 +0300 (Wed, 01 May 2013) $
#$Revision: 83006 $
#$URL: file:///home/coder/svn-repositories/cod/cif/1/50/99/1509936.cif $
#------------------------------------------------------------------------------
#
# This file is available in the Crystallography Open Database (COD),
# http://www.crystallography.net/
#
# All data on this site have been placed in the public domain by the
# contributors.
#
data_1509936
loop_
_publ_author_name
'Mumme, W.G.'
'Herbert, H.K.'
_publ_section_title
;
 Unsubstituted benjaminite from the Aw Mine, N.S.W., a discussion of metal
 substitutions and stability
;
_journal_name_full
;
Neues Jahrbuch fuer Mineralogie. Monatshefte (Band=Jahr) (1950-)
;
_journal_page_first              69
_journal_page_last               80
_journal_volume                  1981
_journal_year                    1981
_chemical_formula_sum            'Ag3 Bi7 S12'
_chemical_name_systematic        'Ag3 Bi7 S12'
_space_group_IT_number           12
_symmetry_space_group_name_Hall  '-C 2y'
_symmetry_space_group_name_H-M   'C 1 2/m 1'
_cell_angle_alpha                90
_cell_angle_beta                 103.14
_cell_angle_gamma                90
_cell_formula_units_Z            2
_cell_length_a                   13.25
_cell_length_b                   4.05
_cell_length_c                   20.25
_cell_volume                     1058.214
_citation_journal_id_ASTM        NJMMAW
_[local]_cod_data_source_file    silver3-x_23.cif
_[local]_cod_data_source_block   Ag3Bi7S12
_cod_database_code               1509936
loop_
_symmetry_equiv_pos_as_xyz
x,y,z
-x,y,-z
-x,-y,-z
x,-y,z
x+1/2,y+1/2,z
-x+1/2,y+1/2,-z
-x+1/2,-y+1/2,-z
x+1/2,-y+1/2,z
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
Ag3 Ag+1 0.08 0 0.2319 0.2 0.0
S5 S-2 0.2361 0.5 0.2846 1 0.0
S1 S-2 0.8628 0.5 0.0282 1 0.0
Bi2 Bi+3 0 0 0.5 1 0.0
Bi4 Bi+3 0.3858 0 0.3208 1 0.0
Ag1 Ag+1 0 0 0 1 0.0
S6 S-2 0.9331 0.5 0.1995 1 0.0
Ag2 Ag+1 0.6979 0 0.4108 0.8 0.0
Bi5 Bi+3 0.08 0 0.2319 0.8 0.0
S3 S-2 0.844 0.5 0.4658 1 0.0
S2 S-2 0.6241 0.5 0.1127 1 0.0
Bi3 Bi+3 0.6979 0 0.4108 0.2 0.0
Bi1 Bi+3 0.7612 0 0.0912 1 0.0
S4 S-2 0.536 0.5 0.3694 1 0.0